6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine

C16H18N6O — CID 56739047

IUPAC6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine
SMILESCC(CNc1ccc(-c2nccn2C)nn1)Oc1cccnc1
InChIInChI=1S/C16H18N6O/c1-12(23-13-4-3-7-17-11-13)10-19-15-6-5-14(20-21-15)16-18-8-9-22(16)2/h3-9,11-12H,10H2,1-2H3,(H,19,21)
InChIKeyYEDZMDRTGZDPTF-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.15
Rot. Bonds6

About 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine

6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine (PubChem CID 56739047) has the molecular formula C16H18N6O and a molecular weight of 310.36 g/mol. Its IUPAC name is 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine
PubChem CID56739047
Molecular FormulaC16H18N6O
Molecular Weight310.36 g/mol
Exact Mass310.15
IUPAC Name6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine
SMILESCC(CNc1ccc(-c2nccn2C)nn1)Oc1cccnc1
InChIInChI=1S/C16H18N6O/c1-12(23-13-4-3-7-17-11-13)10-19-15-6-5-14(20-21-15)16-18-8-9-22(16)2/h3-9,11-12H,10H2,1-2H3,(H,19,21)
InChIKeyYEDZMDRTGZDPTF-UHFFFAOYSA-N
XLogP2.15
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[[4-(Methylamino)-5-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]-3-piperidin-3-yloxypyridine-2-carbonitrile
CID 134508144
Chk1-IN-3
CID 138454800
6-(Benzimidazol-1-Yl)-N-[5-[3-(Dimethylamino)propoxy]pyridin-2-Yl]pyrimidin-4-Amine
CID 76871873
2,3-Dimethyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706803
2-Ethyl-3-methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706865
2-Methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706867
5-[[4-(Methylamino)-5-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]-3-piperidin-4-yloxypyridine-2-carbonitrile
CID 155517225
2-(4-(6-methoxypyridin-3-yl)-5-methyl-4H-1,2,4-triazol-3-yl)-5-phenoxypyrazine
CID 16062053
6-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-N-piperidin-4-ylpyridin-2-amine
CID 25169380
N-(azetidin-3-yl)-6-(6-methoxyimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
CID 44449126
2-methoxy-5-(3-methyl-5-(3-phenoxyazetidin-1-yl)-4H-1,2,4-triazol-4-yl)pyridine
CID 46225083
8-(3-Pyridin-3-yloxyazetidin-1-yl)-2,6,7,12-tetrazatricyclo[7.5.0.03,7]tetradeca-1,3,5,8-tetraene
CID 53323196

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine?
The IUPAC name of 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine (CID 56739047) is 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine.
What is the SMILES notation for 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine?
The canonical SMILES for 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine is CC(CNc1ccc(-c2nccn2C)nn1)Oc1cccnc1.
What is the InChIKey of 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine?
The InChIKey is YEDZMDRTGZDPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O/c1-12(23-13-4-3-7-17-11-13)10-19-15-6-5-14(20-21-15)16-18-8-9-22(16)2/h3-9,11-12H,10H2,1-2H3,(H,19,21).
What are the key properties of 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine?
6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine has a molecular weight of 310.36 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine is sourced from PubChem (CID 56739047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).